UCSF

ZINC12958660

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2008 6 Yes

Popular Name: 1H-Imidazol-4-amine 1H-Imidazol-4-amine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 111005-19-7 , 1261268-96-5 , 4919-03-3

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.47 0.95 -7.19 3 3 0 55 83.094 0 ↓
Mid Mid (pH 6-8) -0.47 1.44 -31.31 4 3 1 56 84.102 0 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
UniProt Database Links APBE_BUCAP; APBE_BUCBP; APBE_CHLMU; APBE_CHLPN; APBE_CHLTR; APBE_ECO57; APBE_ECOLI; APBE_HAEIN; APBE_SALTY; APBE_TREPA; HIS3_ARATH; HIS41_PHOLL; HIS41_RUEPO; HIS41_RUEST; HIS42_PHOLL; HIS42_RUEPO; HIS42_RUEST; HIS4_ACAM1; HIS4_ACIAC; HIS4_ACIAD; HIS4_ACIB ChEBI

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.